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(E)-9-(4-Chlorobenzylidene)-5-(4-chlorophenyl)-3-methyl-6,7,8,9-tetrahydro-5H-thiazolo[2,3-b]quinazoline
SpectraBase Compound ID 3voTBDGeoSF
InChI InChI=1S/C24H20Cl2N2S/c1-15-14-29-24-27-22-18(13-16-5-9-19(25)10-6-16)3-2-4-21(22)23(28(15)24)17-7-11-20(26)12-8-17/h5-14,23H,2-4H2,1H3/b18-13+
InChIKey KAXWCSUTANBPKO-QGOAFFKASA-N
Mol Weight 439.4 g/mol
Molecular Formula C24H20Cl2N2S
Exact Mass 438.072425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9CabQbd1aS
Name (E)-9-(4-Chlorobenzylidene)-5-(4-chlorophenyl)-3-methyl-6,7,8,9-tetrahydro-5H-thiazolo[2,3-b]quinazoline
Alternate Name(s) (9E)-5-(4-chlorophenyl)-9-[(4-chlorophenyl)methylidene]-3-methyl-5,6,7,8-tetrahydrothiazolo[2,3-b]quinazoline (9E)-5-(4-chlorophenyl)-9-[(4-chlorophenyl)methylene]-3-methyl-5,6,7,8-tetrahydrothiazolo[2,3-b]quinazoline (9E)-5-(4-chlorophenyl)-9-[(4-chlorophenyl)methylidene]-3-methyl-5,6,7,8-tetrahydro-[1,3]thiazolo[2,3-b]quinazoline
Comments Less than 3 mono-isotopic peaks
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Formula C24H20Cl2N2S
InChI InChI=1S/C24H20Cl2N2S/c1-15-14-29-24-27-22-18(13-16-5-9-19(25)10-6-16)3-2-4-21(22)23(28(15)24)17-7-11-20(26)12-8-17/h5-14,23H,2-4H2,1H3/b18-13+
InChIKey KAXWCSUTANBPKO-QGOAFFKASA-N
Molecular Weight 439.404 g/mol
SMILES C12=NC=3\C(=C\c4ccc(cc4)Cl)CCCC3C(N1C(C)=CS2)c1ccc(cc1)Cl
SPLASH splash10-000i-0000900000-1ae37ce8e453e35a951e
Source of Spectrum F2-47-70-17
Wiley ID 1706194